SCHEMBL9300266

SCHEMBL9300266

OC(COc1ccccc1Cl)(c1cccnc1)C1(Cl)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 2/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ CYP3A4 P08684 3/20 0.41
▸ CYP3A5 P20815 2/20 0.41
▸ CYP19A1 P11511 6/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ KCNA5 P22460 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SLC12A2 P55011 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ SLC12A5 Q9H2X9 1/20 0.38
▸ VCP P55072 1/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9301509 0.87 MEN1 (0.44) CYP3A4CYP3A5CYP19A1LMNAMAPK1
SCHEMBL9300288 0.81 CYP19A1 (0.49) CYP3A4CYP3A5CYP19A1
SCHEMBL9301221 0.81 LMNA (0.46) CYP3A4CYP3A5CYP19A1LMNASMN1; SMN2
SCHEMBL934753 0.78 CYP19A1 (0.41) CYP3A4CYP3A5CYP19A1LMNAKCNA5
SCHEMBL9301005 0.78 CYP19A1 (0.46) RAB9ACYP3A4CYP3A5CYP19A1KCNA5
SCHEMBL9372057 0.65 CYP19A1 (0.49) CYP3A4CYP3A5CYP19A1LMNAMAPK1
SCHEMBL19139302 0.64 MCHR1 (0.47) HTTHPGD
SCHEMBL9372144 0.63 NOTUM (0.46) NOTUMCYP3A4CYP19A1KCNA5SMN1; SMN2
SCHEMBL27368720 0.62 CYP3A4 (0.86) CYP3A4CYP3A5CYP19A1KCNA5CYP1A2
SCHEMBL11629409 0.62 CYP3A4 (0.62) CYP3A4CYP3A5CYP19A1LMNAKCNA5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5356899-A Pesticides BAYER AKTIENGESELLSCHAFT (DE) 1994-10-18 — — US claimed
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